COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK513488
Chemical Name: (4Z)-4-{1-[(4-fluorobenzyl)amino]ethylidene}-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1)C1=NN(C(=O)/C/1=C(\NCc1ccc(cc1)F)/C)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 460.46
Empirical Formula: C25H21FN4O4

Available Amount: 0 mg

Lipinsky:
logP: 4.068
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 4

     

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